tert-Butyl 3-chloropiperidine-1-carboxylate

Basic Information

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CAS Number

885275-01-4

Molecular Formula

C10H18ClNO2

Molecular Weight

219.71 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

290℃

Density

1.11

Flash Point

129℃

SMILES

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CC(C)(C)OC(=O)N1CCCC(C1)Cl

InChI

InChI=1S/C10H18ClNO2/c1-10(2,3)14-9(13)12-6-4-5-8(11)7-12/h8H,4-7H2,1-3H3

InChIKey

JPSPBVBCTKBAEJ-UHFFFAOYSA-N

LogP

2.6247000000000007

Topological Polar Surface Area

29.540000000000003 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

213

Synonyms & References

English

tert-Butyl 3-chloropiperidine-1-carboxylate
1-Boc-3-chloropiperidine
1-Boc-3-chloro-piperidine
1-Piperidinecarboxylicacid, 3-chloro-, 1,1-dimethylethyl ester
3-Chloro-piperidine-1-carboxylic acid tert-butyl ester
HT907
1,1-Dimethylethyl 3-chloro-1-piperidinecarboxylate (ACI)
SB39434
G84554
DTXSID90693541
MFCD08059310
AKOS015897948
DB-077616
tert-Butyl-3-chloro-1-piperidine carboxylate
CS-0069647
tert-Butyl3-chloropiperidine-1-carboxylate
885275-01-4
SCHEMBL18173584
J-524533
1-BOC-3-CHLORO-PIPERIDINE

MDL Number

MFCD08059310

Customs Code

2933399090

FAQ

What regulatory guidelines apply to tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4)?

Regulatory guidelines for tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4) include GHS classification, which categorizes it based on its hazardous properties. It must comply with REACH regulations for substances and mixtures in the European Union. Additionally, the FDA may require specific registration for its use in pharmaceutical applications, while the EPA enforces environmental protection measures for its disposal and handling.

Are there alternatives to tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4) in synthesis?

In synthesis, tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4) can be replaced with other amide derivatives, such as tert-Butyl 2-chloropiperidine-1-carboxylate or tert-Butyl 4-chloropiperidine-1-carboxylate, which may offer similar functionalities. Other alternatives include using different functional groups or isomers to achieve the desired molecular structure.

What is the market or research trend for tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4)?

The market for tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4) reflects an increasing interest in its use as a building block in the synthesis of various pharmaceuticals and agrochemicals. Research trends indicate growing demand in the development of novel drugs, particularly in the field of antivirals and anticancer agents, driven by its unique chemical properties.

How should waste containing tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4) be handled?

Waste containing tert-Butyl 3-chloropiperidine-1-carboxylate (CAS: 885275-01-4) should be collected in appropriate containers and stored separately to prevent contamination. For disposal, it is recommended to incinerate the waste in a controlled incineration facility or use a professional waste disposal service that adheres to environmental protection precautions. Always follow local and national regulations regarding hazardous chemical waste management.